Vitas-M small molecule compound
2-{[4-(furan-2-ylmethyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methoxyphenyl)ethanone
Catalog ID
STL338997
SMILES COc1ccc(cc1)C(=O)CSc1nnc(n1Cc1ccco1)c1cccnc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H18N4O3S MW 406.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O3S/c1-27-17-8-6-15(7-9-17)19(26)14-29-21-24-23-20(16-4-2-10-22-12-16)25(21)13-18-5-3-11-28-18/h2-12H,13-14H2,1H3InChIKey
QEAFTOMVCPYDFX-UHFFFAOYSA-NSynonyms
678985-82-52((4(furan2ylmethyl)5(pyridin3yl)4H124triazol3yl)sulfanyl)1(4methoxyphenyl)ethanone
2((4(furan2ylmethyl)5(pyridin3yl)4H124triazol3yl)thio)1(4methoxyphenyl)ethanone
2((4(FURAN2YLMETHYL)5PYRIDIN3YL124TRIAZOL3YL)SULFANYL)1(4METHOXYPHENYL)ETHANONE
2(4(2FURYLMETHYL)5(3PYRIDYL)(124TRIAZOL3YLTHIO))1(4METHOXYPHENYL)ETHAN1ONE
678985825
COC1=CC=C(C=C1)C(=O)CSC2=NN=C(N2CC3=CC=CO3)C4=CN=CC=C4
InChI=1SC21H18N4O3Sc127178615(7917)19(26)142921242320(164210221216)25(21)131853112818h212H1314H21H3
MFCD04007919
ZINC000002265359
ZINC02265359
ZINC2265359
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